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1,3-dimethyl-6-{[3-methyl-4-(3-methylphenyl)-1-piperazinyl]sulfonyl}-2,4(1H,3H)-quinazolinedione
SpectraBase Compound ID 2wPOoogmrVw
InChI InChI=1S/C22H26N4O4S/c1-15-6-5-7-17(12-15)26-11-10-25(14-16(26)2)31(29,30)18-8-9-20-19(13-18)21(27)24(4)22(28)23(20)3/h5-9,12-13,16H,10-11,14H2,1-4H3
InChIKey PJIVAZCKFCNEMT-UHFFFAOYSA-N
Mol Weight 442.53 g/mol
Molecular Formula C22H26N4O4S
Exact Mass 442.167477 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 17ft8LhRtBA
Name 1,3-dimethyl-6-{[3-methyl-4-(3-methylphenyl)-1-piperazinyl]sulfonyl}-2,4(1H,3H)-quinazolinedione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.167476503 u
Formula C22H26N4O4S
InChI InChI=1S/C22H26N4O4S/c1-15-6-5-7-17(12-15)26-11-10-25(14-16(26)2)31(29,30)18-8-9-20-19(13-18)21(27)24(4)22(28)23(20)3/h5-9,12-13,16H,10-11,14H2,1-4H3
InChIKey PJIVAZCKFCNEMT-UHFFFAOYSA-N
Molecular Weight 442.534 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4757
Solvent DMSO-d6
Source Vendor ID: NMR/12309847